ethyl (2R)-2-(cyclopentylamino)butanoate

C11H21NO2 — CID 25004005

IUPACethyl (2R)-2-(cyclopentylamino)butanoate
SMILESCCOC(=O)[C@@H](CC)NC1CCCC1
InChIInChI=1S/C11H21NO2/c1-3-10(11(13)14-4-2)12-9-7-5-6-8-9/h9-10,12H,3-8H2,1-2H3/t10-/m1/s1
InChIKeyYTRHJKHXNQGZLA-SNVBAGLBSA-N
MW199.29 g/mol
LogP1.86
Rot. Bonds5

About ethyl (2R)-2-(cyclopentylamino)butanoate

ethyl (2R)-2-(cyclopentylamino)butanoate (PubChem CID 25004005) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is ethyl (2R)-2-(cyclopentylamino)butanoate.

Molecular Properties

Compound Nameethyl (2R)-2-(cyclopentylamino)butanoate
PubChem CID25004005
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Nameethyl (2R)-2-(cyclopentylamino)butanoate
SMILESCCOC(=O)[C@@H](CC)NC1CCCC1
InChIInChI=1S/C11H21NO2/c1-3-10(11(13)14-4-2)12-9-7-5-6-8-9/h9-10,12H,3-8H2,1-2H3/t10-/m1/s1
InChIKeyYTRHJKHXNQGZLA-SNVBAGLBSA-N
XLogP1.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl (2R)-2-(cyclopentylamino)butanoate?
The IUPAC name of ethyl (2R)-2-(cyclopentylamino)butanoate (CID 25004005) is ethyl (2R)-2-(cyclopentylamino)butanoate.
What is the SMILES notation for ethyl (2R)-2-(cyclopentylamino)butanoate?
The canonical SMILES for ethyl (2R)-2-(cyclopentylamino)butanoate is CCOC(=O)[C@@H](CC)NC1CCCC1.
What is the InChIKey of ethyl (2R)-2-(cyclopentylamino)butanoate?
The InChIKey is YTRHJKHXNQGZLA-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-10(11(13)14-4-2)12-9-7-5-6-8-9/h9-10,12H,3-8H2,1-2H3/t10-/m1/s1.
What are the key properties of ethyl (2R)-2-(cyclopentylamino)butanoate?
ethyl (2R)-2-(cyclopentylamino)butanoate has a molecular weight of 199.29 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2R)-2-(cyclopentylamino)butanoate is sourced from PubChem (CID 25004005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).